2-(3-Ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethyl acetate
Basic information
- CAS
23509-57-1- Standard SMILES
CCN1C(=S)SC(CCOC(C)=O)C1(C)O- InChIKey
TXUPLYBMAQHKQU-UHFFFAOYSA-N- Molecular formula
- C10H17NO3S2
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.06498575
Names & identifiers
- Preferred name
- 2-(3-Ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethyl acetate
- IUPAC
- 2-(3-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethyl acetate
Names & synonyms
23509-57-1DTXSID309462002-(3-ethyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethyl acetateRefChem:1061080DTXCID5013744913-Ethyl-4-hydroxy-5-(2-hydroxyethyl)-4-methyl-2-thiazolidinethione 5-acetate2-Thiazolidinethione, 3-ethyl-4-hydroxy-5-(2-hydroxyethyl)-4-methyl-, 5-acetate
Database identifiers
- CAS
23509-57-1- PubChem CID
- 211638
- DTXSID
DTXSID30946200
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…